Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK594061
SMILES CC1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H25ClFN5O2 MW 433.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClFN5O2/c1-13-7-9-27(10-8-13)12-17-24-19-18(20(29)26(3)21(30)25(19)2)28(17)11-14-15(22)5-4-6-16(14)23/h4-6,13H,7-12H2,1-3H3InChIKey
FFADTDSXGQGXDF-UHFFFAOYSA-NSynonyms
851938-50-67((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYL8((4METHYLPIPERIDIN1YL)METHYL)PURINE26DIONE
7(2chloro6fluorobenzyl)13dimethyl8((4methylpiperidin1yl)methyl)1Hpurine26(3H7H)dione
7(2chloro6fluorobenzyl)13dimethyl8((4methylpiperidin1yl)methyl)37dihydro1Hpurine26dione
851938506
CC1CCN(CC1)CC2=NC3=C(N2CC4=C(C=CC=C4Cl)F)C(=O)N(C(=O)N3C)C
InChI=1SC21H25ClFN5O2c1137927(10813)1217241918(20(29)26(3)21(30)25(19)2)28(17)111415(22)54616(14)23h4613H712H213H3
MFCD04466351
ZINC000002354703
ZINC2354703
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